Furfurylamine → HCID 67214769, compound

HRID 681862Notes

Reaction equation

HRID 681862 reaction equation
[CH2:63]([NH2:64])[c:65]1[o:66][cH:67][cH:68][cH:69]1.[CH3:23][c:24]1[cH:25][cH:26][c:27]([C:28]([OH:29])=[O:30])[cH:31][c:32]1[NH:33][c:34]1[n:35][c:36](-[c:37]2[cH:38][n:39][cH:40][cH:41][cH:42]2)[cH:43][cH:44][n:45]1.[CH3:46][c:47]1[n:48][cH:49][n:50](-[c:52]2[cH:53][c:54]([C:59]([F:60])([F:61])[F:62])[cH:55][c:56]([NH2:58])[cH:57]2)[cH:51]1.[n:1]1[cH:2][c:3](-[c:7]2[n:8][c:9]([NH:13][c:14]3[cH:15][c:16]([C:17](=[O:18])[OH:19])[cH:20][cH:21][cH:22]3)[n:10][cH:11][cH:12]2)[cH:4][cH:5][cH:6]1>>[n:1]1[cH:2][c:3](-[c:7]2[n:8][c:9]([NH:13][c:14]3[cH:15][c:16]([C:17](=[O:19])[NH:58][c:56]4[cH:55][c:54]([C:59]([F:60])([F:61])[F:62])[cH:53][c:52](-[n:50]5[cH:49][n:48][c:47]([CH3:46])[cH:51]5)[cH:57]4)[cH:20][cH:21][cH:22]3)[n:10][cH:11][cH:12]2)[cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 3438FurfurylamineHCID 10039959HCID 10039959, compoundHCID 104028804-Methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}benzoic acidHCID 120028253-(4-Methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)aniline

Product 1

HCID 67214769HCID 67214769, compound

Sources & evidence

ORD record
ord-22cee59be3c14975abcac53f56cd2e8e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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